14
HEAT OF FORMATION =    -27.901 KCAL =   -116.818 KJ; FOR REACTION COORDINATE =      0.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.161      1.362      0.000
H      1.881    -0.5668     0.8996
H      1.881    -0.5663    -0.9001
C    -0.6427      1.362      0.000
H    -0.3629    -0.5668    -0.8996
H    -0.3626    -0.5663     0.9001
H      1.865      1.945     0.9054
H      3.273      1.257  0.0002313
H      1.866      1.945    -0.9056
H    -0.3475      1.945    -0.9054
H     -1.755      1.257 -0.0002313
H    -0.3479      1.945     0.9056
14
HEAT OF FORMATION =    -27.943 KCAL =   -116.992 KJ; FOR REACTION COORDINATE =      5.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.160      1.362      0.000
H      1.880    -0.5684     0.8987
H      1.881    -0.5642    -0.9012
C    -0.6422      1.357    -0.1187
H    -0.3622    -0.6446    -0.8458
H    -0.3633    -0.4835     0.9469
H      1.865      1.944     0.9059
H      3.273      1.257 -3.067e-05
H      1.865      1.946    -0.9051
H    -0.3468      1.858     -1.072
H     -1.755      1.252    -0.1095
H    -0.3468      2.017     0.7321
14
HEAT OF FORMATION =    -28.063 KCAL =   -117.493 KJ; FOR REACTION COORDINATE =     10.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.158      1.363      0.000
H      1.880    -0.5717     0.8962
H      1.880    -0.5615    -0.9034
C    -0.6406      1.342    -0.2367
H    -0.3626    -0.7178    -0.7841
H    -0.3629    -0.3964     0.9870
H      1.856      1.947     0.9023
H      3.271      1.260   0.007951
H      1.868      1.943    -0.9085
H    -0.3380      1.761     -1.227
H     -1.753      1.240    -0.2267
H    -0.3499      2.072     0.5572
14
HEAT OF FORMATION =    -28.248 KCAL =   -118.267 KJ; FOR REACTION COORDINATE =     15.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.155      1.364      0.000
H      1.879    -0.5728     0.8955
H      1.880    -0.5590    -0.9051
C    -0.6374      1.318    -0.3531
H    -0.3620    -0.7850    -0.7167
H    -0.3627    -0.3057      1.019
H      1.840      1.952     0.8961
H      3.268      1.265    0.02045
H      1.873      1.939    -0.9148
H    -0.3230      1.654     -1.371
H     -1.750      1.216    -0.3471
H    -0.3552      2.110     0.3817
14
HEAT OF FORMATION =    -28.483 KCAL =   -119.251 KJ; FOR REACTION COORDINATE =     20.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.150      1.367      0.000
H      1.879    -0.5731     0.8952
H      1.880    -0.5571    -0.9060
C    -0.6325      1.284    -0.4674
H    -0.3617    -0.8448    -0.6452
H    -0.3633    -0.2136      1.042
H      1.817      1.960     0.8857
H      3.262      1.272    0.04047
H      1.881      1.933    -0.9242
H    -0.2995      1.539     -1.503
H     -1.745      1.182    -0.4731
H    -0.3636      2.132     0.2074
14
HEAT OF FORMATION =    -28.751 KCAL =   -120.375 KJ; FOR REACTION COORDINATE =     25.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.144      1.369      0.000
H      1.877    -0.5732     0.8953
H      1.880    -0.5557    -0.9067
C    -0.6274      1.241    -0.5786
H    -0.3609    -0.8979    -0.5692
H    -0.3636    -0.1205      1.057
H      1.791      1.968     0.8741
H      3.256      1.280    0.06163
H      1.889      1.926    -0.9340
H    -0.2749      1.415     -1.624
H     -1.740      1.134    -0.5967
H    -0.3729      2.140    0.03248
14
HEAT OF FORMATION =    -29.036 KCAL =   -121.568 KJ; FOR REACTION COORDINATE =     30.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.137      1.372      0.000
H      1.877    -0.5723     0.8958
H      1.880    -0.5546    -0.9069
C    -0.6205      1.189    -0.6862
H    -0.3607    -0.9435    -0.4896
H    -0.3644   -0.02686      1.063
H      1.763      1.977     0.8614
H      3.248      1.291    0.08383
H      1.897      1.919    -0.9439
H    -0.2469      1.282     -1.735
H     -1.732      1.076    -0.7179
H    -0.3805      2.134    -0.1422
14
HEAT OF FORMATION =    -29.320 KCAL =   -122.758 KJ; FOR REACTION COORDINATE =     35.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.129      1.376      0.000
H      1.877    -0.5699     0.8972
H      1.881    -0.5540    -0.9066
C    -0.6136      1.127    -0.7891
H    -0.3607    -0.9819    -0.4071
H    -0.3651    0.06619      1.061
H      1.737      1.985     0.8495
H      3.239      1.301     0.1035
H      1.902      1.913    -0.9524
H    -0.2207      1.139     -1.835
H     -1.723      1.007    -0.8311
H    -0.3864      2.114    -0.3173
14
HEAT OF FORMATION =    -29.588 KCAL =   -123.879 KJ; FOR REACTION COORDINATE =     40.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.122      1.379      0.000
H      1.875    -0.5680     0.8986
H      1.881    -0.5545    -0.9058
C    -0.6066      1.056    -0.8863
H    -0.3602     -1.013    -0.3233
H    -0.3660     0.1574      1.050
H      1.712      1.992     0.8391
H      3.230      1.312     0.1204
H      1.905      1.908    -0.9595
H    -0.1968     0.9863     -1.923
H     -1.715     0.9276    -0.9356
H    -0.3901      2.079    -0.4916
14
HEAT OF FORMATION =    -29.826 KCAL =   -124.876 KJ; FOR REACTION COORDINATE =     45.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.115      1.382      0.000
H      1.875    -0.5652     0.9005
H      1.882    -0.5553    -0.9047
C    -0.6003     0.9770    -0.9770
H    -0.3600     -1.036    -0.2371
H    -0.3670     0.2471      1.032
H      1.694      1.996     0.8325
H      3.223      1.321     0.1307
H      1.904      1.906    -0.9638
H    -0.1793     0.8226     -2.000
H     -1.708     0.8418     -1.027
H    -0.3896      2.029    -0.6661
14
HEAT OF FORMATION =    -30.026 KCAL =   -125.713 KJ; FOR REACTION COORDINATE =     50.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.110      1.384      0.000
H      1.874    -0.5628     0.9022
H      1.882    -0.5561    -0.9037
C    -0.5954     0.8896     -1.060
H    -0.3597     -1.053    -0.1497
H    -0.3678     0.3349      1.007
H      1.685      1.997     0.8311
H      3.218      1.328     0.1319
H      1.899      1.906    -0.9647
H    -0.1705     0.6471     -2.064
H     -1.703     0.7525     -1.102
H    -0.3840      1.964    -0.8399
14
HEAT OF FORMATION =    -30.186 KCAL =   -126.381 KJ; FOR REACTION COORDINATE =     55.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.106      1.386      0.000
H      1.874    -0.5597     0.9042
H      1.883    -0.5578    -0.9020
C    -0.5914     0.7948     -1.135
H    -0.3597     -1.062   -0.06094
H    -0.3689     0.4186     0.9743
H      1.684      1.995     0.8354
H      3.214      1.332     0.1250
H      1.886      1.910    -0.9617
H    -0.1695     0.4602     -2.114
H     -1.700     0.6619     -1.163
H    -0.3716      1.883     -1.013
14
HEAT OF FORMATION =    -30.308 KCAL =   -126.893 KJ; FOR REACTION COORDINATE =     60.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.103      1.387      0.000
H      1.874    -0.5559     0.9066
H      1.884    -0.5599    -0.8997
C    -0.5887     0.6935     -1.201
H    -0.3597     -1.063    0.02819
H    -0.3701     0.4994     0.9347
H      1.694      1.990     0.8463
H      3.214      1.336     0.1076
H      1.868      1.917    -0.9544
H    -0.1795     0.2621     -2.147
H     -1.699     0.5748     -1.211
H    -0.3532      1.785     -1.183
14
HEAT OF FORMATION =    -30.396 KCAL =   -127.264 KJ; FOR REACTION COORDINATE =     65.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.100      1.388      0.000
H      1.874    -0.5536     0.9081
H      1.885    -0.5618    -0.8980
C    -0.5859     0.5867     -1.258
H    -0.3599     -1.057     0.1180
H    -0.3709     0.5764     0.8887
H      1.711      1.981     0.8627
H      3.213      1.338    0.07935
H      1.841      1.930    -0.9418
H    -0.1972    0.05550     -2.160
H     -1.699     0.4936     -1.246
H    -0.3263      1.669     -1.351
14
HEAT OF FORMATION =    -30.453 KCAL =   -127.500 KJ; FOR REACTION COORDINATE =     70.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.098      1.390      0.000
H      1.875    -0.5510     0.9093
H      1.886    -0.5624    -0.8970
C    -0.5833     0.4752     -1.306
H    -0.3609     -1.043     0.2067
H    -0.3720     0.6506     0.8352
H      1.732      1.971     0.8804
H      3.212      1.341    0.04760
H      1.809      1.941    -0.9275
H    -0.2176    -0.1530     -2.154
H     -1.698     0.4140     -1.277
H    -0.2951      1.535     -1.507
14
HEAT OF FORMATION =    -30.471 KCAL =   -127.577 KJ; FOR REACTION COORDINATE =     75.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.095      1.391      0.000
H      1.877    -0.5482     0.9103
H      1.888    -0.5632    -0.8956
C    -0.5799     0.3601     -1.344
H    -0.3627     -1.021     0.2939
H    -0.3738     0.7193     0.7757
H      1.750      1.962     0.8960
H      3.210      1.346    0.01757
H      1.780      1.951    -0.9135
H    -0.2356    -0.3576     -2.127
H     -1.696     0.3314     -1.305
H    -0.2649      1.387     -1.649
14
HEAT OF FORMATION =    -30.445 KCAL =   -127.466 KJ; FOR REACTION COORDINATE =     80.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.091      1.393      0.000
H      1.880    -0.5463     0.9107
H      1.890    -0.5631    -0.8949
C    -0.5757     0.2419     -1.372
H    -0.3644    -0.9917     0.3799
H    -0.3752     0.7836     0.7100
H      1.770      1.953     0.9115
H      3.207      1.352   -0.01331
H      1.748      1.962    -0.8982
H    -0.2544    -0.5585     -2.081
H     -1.692     0.2478     -1.329
H    -0.2332      1.225     -1.776
14
HEAT OF FORMATION =    -30.368 KCAL =   -127.147 KJ; FOR REACTION COORDINATE =     85.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.088      1.394      0.000
H      1.882    -0.5447     0.9109
H      1.893    -0.5634    -0.8939
C    -0.5726     0.1215     -1.389
H    -0.3662    -0.9549     0.4633
H    -0.3770     0.8414     0.6391
H      1.782      1.947     0.9207
H      3.204      1.356   -0.03300
H      1.728      1.968    -0.8884
H    -0.2660    -0.7475     -2.020
H     -1.688     0.1511     -1.348
H    -0.2124      1.057     -1.883
14
HEAT OF FORMATION =    -30.249 KCAL =   -126.646 KJ; FOR REACTION COORDINATE =     90.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.087      1.395      0.000
H      1.884    -0.5444     0.9106
H      1.895    -0.5636    -0.8932
C    -0.5706  8.542e-17     -1.395
H    -0.3673    -0.9106     0.5444
H    -0.3785     0.8932     0.5636
H      1.784      1.946     0.9228
H      3.203      1.359   -0.03760
H      1.722      1.969    -0.8861
H    -0.2671    -0.9228     -1.946
H     -1.686    0.03760     -1.359
H    -0.2054     0.8861     -1.969
14
HEAT OF FORMATION =    -30.104 KCAL =   -126.038 KJ; FOR REACTION COORDINATE =     95.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.088      1.395      0.000
H      1.886    -0.5437     0.9104
H      1.897    -0.5630    -0.8928
C    -0.5707    -0.1216     -1.390
H    -0.3686    -0.8596     0.6210
H    -0.3804     0.9384     0.4831
H      1.784      1.946     0.9229
H      3.203      1.359   -0.03849
H      1.721      1.968    -0.8862
H    -0.2676     -1.089     -1.858
H     -1.686   -0.08012     -1.357
H    -0.2044     0.7113     -2.038
14
HEAT OF FORMATION =    -29.954 KCAL =   -125.411 KJ; FOR REACTION COORDINATE =    100.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.089      1.395      0.000
H      1.887    -0.5439     0.9099
H      1.899    -0.5626    -0.8925
C    -0.5714    -0.2422     -1.374
H    -0.3696    -0.8016     0.6936
H    -0.3817     0.9767     0.3991
H      1.780      1.949     0.9196
H      3.204      1.358   -0.03125
H      1.729      1.966    -0.8899
H    -0.2627     -1.244     -1.759
H     -1.687    -0.2051     -1.343
H    -0.2112     0.5350     -2.091
14
HEAT OF FORMATION =    -29.821 KCAL =   -124.853 KJ; FOR REACTION COORDINATE =    105.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.090      1.395      0.000
H      1.889    -0.5450     0.9086
H      1.901    -0.5612    -0.8930
C    -0.5721    -0.3610     -1.347
H    -0.3708    -0.7366     0.7616
H    -0.3832      1.008     0.3109
H      1.777      1.951     0.9167
H      3.206      1.357   -0.02461
H      1.736      1.965    -0.8930
H    -0.2590     -1.390     -1.647
H     -1.688    -0.3274     -1.317
H    -0.2182     0.3541     -2.129
14
HEAT OF FORMATION =    -29.720 KCAL =   -124.430 KJ; FOR REACTION COORDINATE =    110.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.394      0.000
H      1.890    -0.5464     0.9076
H      1.902    -0.5596    -0.8937
C    -0.5726    -0.4769     -1.310
H    -0.3714    -0.6659     0.8238
H    -0.3840      1.031     0.2202
H      1.772      1.953     0.9131
H      3.207      1.356   -0.01702
H      1.743      1.962    -0.8970
H    -0.2534     -1.526     -1.523
H     -1.689    -0.4479     -1.280
H    -0.2253     0.1718     -2.151
14
HEAT OF FORMATION =    -29.660 KCAL =   -124.180 KJ; FOR REACTION COORDINATE =    115.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.394      0.000
H      1.890    -0.5472     0.9069
H      1.902    -0.5597    -0.8936
C    -0.5727    -0.5893     -1.264
H    -0.3716    -0.5907     0.8792
H    -0.3841      1.047     0.1258
H      1.769      1.954     0.9114
H      3.207      1.356   -0.01340
H      1.747      1.961    -0.8991
H    -0.2507     -1.652     -1.386
H     -1.689    -0.5608     -1.234
H    -0.2289   -0.01384     -2.157
14
HEAT OF FORMATION =    -29.651 KCAL =   -124.142 KJ; FOR REACTION COORDINATE =    120.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.394      0.000
H      1.891    -0.5504     0.9041
H      1.903    -0.5554    -0.8965
C    -0.5728    -0.6972     -1.208
H    -0.3728    -0.5085     0.9284
H    -0.3849      1.054    0.03401
H      1.754      1.960     0.9021
H      3.207      1.355   0.005602
H      1.763      1.956    -0.9080
H    -0.2360     -1.761     -1.246
H     -1.689    -0.6826     -1.171
H    -0.2444    -0.1914     -2.148
14
HEAT OF FORMATION =    -29.690 KCAL =   -124.305 KJ; FOR REACTION COORDINATE =    125.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.394      0.000
H      1.892    -0.5537     0.9018
H      1.901    -0.5528    -0.8989
C    -0.5724    -0.7998     -1.142
H    -0.3733    -0.4219     0.9705
H    -0.3842      1.053   -0.06246
H      1.746      1.963     0.8974
H      3.207      1.356    0.01505
H      1.770      1.953    -0.9125
H    -0.2278     -1.861     -1.093
H     -1.688    -0.7899     -1.102
H    -0.2517    -0.3728     -2.123
14
HEAT OF FORMATION =    -29.776 KCAL =   -124.666 KJ; FOR REACTION COORDINATE =    130.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.089      1.395      0.000
H      1.892    -0.5556     0.8999
H      1.901    -0.5504    -0.9007
C    -0.5710    -0.8967     -1.069
H    -0.3744    -0.3322      1.004
H    -0.3832      1.044    -0.1575
H      1.737      1.966     0.8931
H      3.205      1.357    0.02349
H      1.775      1.951    -0.9165
H    -0.2193     -1.948    -0.9319
H     -1.687    -0.8904     -1.025
H    -0.2567    -0.5517     -2.083
14
HEAT OF FORMATION =    -29.904 KCAL =   -125.201 KJ; FOR REACTION COORDINATE =    135.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.087      1.396      0.000
H      1.892    -0.5572     0.8990
H      1.900    -0.5489    -0.9021
C    -0.5693    -0.9868    -0.9868
H    -0.3741    -0.2415      1.030
H    -0.3823      1.026    -0.2503
H      1.728      1.969     0.8889
H      3.203      1.359    0.03162
H      1.779      1.948    -0.9204
H    -0.2102     -2.021    -0.7635
H     -1.685    -0.9835    -0.9388
H    -0.2610    -0.7267     -2.028
14
HEAT OF FORMATION =    -30.065 KCAL =   -125.876 KJ; FOR REACTION COORDINATE =    140.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.085      1.396      0.000
H      1.892    -0.5589     0.8976
H      1.898    -0.5470    -0.9038
C    -0.5675     -1.070    -0.8975
H    -0.3743    -0.1487      1.047
H    -0.3808      1.000    -0.3407
H      1.718      1.971     0.8846
H      3.200      1.362    0.03891
H      1.781      1.946    -0.9237
H    -0.2007     -2.079    -0.5894
H     -1.683     -1.069    -0.8458
H    -0.2637    -0.8968     -1.958
14
HEAT OF FORMATION =    -30.249 KCAL =   -126.647 KJ; FOR REACTION COORDINATE =    145.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.082      1.397      0.000
H      1.890    -0.5598     0.8972
H      1.896    -0.5467    -0.9047
C    -0.5655     -1.144    -0.8012
H    -0.3738   -0.05605      1.056
H    -0.3793     0.9667    -0.4275
H      1.712      1.972     0.8826
H      3.198      1.364    0.04334
H      1.781      1.945    -0.9258
H    -0.1951     -2.122    -0.4084
H     -1.681     -1.142    -0.7470
H    -0.2648     -1.062     -1.874
14
HEAT OF FORMATION =    -30.444 KCAL =   -127.463 KJ; FOR REACTION COORDINATE =    150.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.079      1.398      0.000
H      1.890    -0.5602     0.8968
H      1.894    -0.5454    -0.9060
C    -0.5625     -1.211    -0.6990
H    -0.3741    0.03680      1.057
H    -0.3779     0.9253    -0.5120
H      1.704      1.974     0.8805
H      3.194      1.368    0.04695
H      1.780      1.944    -0.9275
H    -0.1877     -2.150    -0.2244
H     -1.678     -1.208    -0.6433
H    -0.2639     -1.220     -1.775
14
HEAT OF FORMATION =    -30.637 KCAL =   -128.269 KJ; FOR REACTION COORDINATE =    155.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.077      1.399      0.000
H      1.889    -0.5605     0.8969
H      1.892    -0.5460    -0.9062
C    -0.5611     -1.268    -0.5911
H    -0.3733     0.1290      1.050
H    -0.3765     0.8778    -0.5905
H      1.702      1.974     0.8811
H      3.192      1.369    0.04590
H      1.777      1.945    -0.9270
H    -0.1866     -2.161   -0.03557
H     -1.677     -1.261    -0.5371
H    -0.2610     -1.371     -1.662
14
HEAT OF FORMATION =    -30.814 KCAL =   -129.013 KJ; FOR REACTION COORDINATE =    160.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.074      1.399      0.000
H      1.888    -0.5595     0.8979
H      1.890    -0.5470    -0.9060
C    -0.5593     -1.315    -0.4785
H    -0.3727     0.2187      1.035
H    -0.3753     0.8239    -0.6642
H      1.701      1.973     0.8823
H      3.190      1.372    0.04360
H      1.771      1.946    -0.9258
H    -0.1855     -2.156     0.1543
H     -1.675     -1.304    -0.4281
H    -0.2563     -1.512     -1.535
14
HEAT OF FORMATION =    -30.966 KCAL =   -129.647 KJ; FOR REACTION COORDINATE =    165.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.072      1.400      0.000
H      1.887    -0.5585     0.8987
H      1.889    -0.5485    -0.9053
C    -0.5576     -1.352    -0.3623
H    -0.3725     0.3069      1.013
H    -0.3742     0.7641    -0.7325
H      1.703      1.971     0.8855
H      3.188      1.374    0.03696
H      1.763      1.948    -0.9229
H    -0.1878     -2.133     0.3452
H     -1.673     -1.337    -0.3199
H    -0.2483     -1.642     -1.396
14
HEAT OF FORMATION =    -31.081 KCAL =   -130.131 KJ; FOR REACTION COORDINATE =    170.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.071      1.400      0.000
H      1.887    -0.5567     0.9000
H      1.888    -0.5496    -0.9046
C    -0.5561     -1.379    -0.2432
H    -0.3724     0.3920     0.9830
H    -0.3735     0.6983    -0.7955
H      1.710      1.967     0.8924
H      3.187      1.375    0.02435
H      1.751      1.952    -0.9172
H    -0.1959     -2.092     0.5373
H     -1.672     -1.359    -0.2149
H    -0.2365     -1.763     -1.242
14
HEAT OF FORMATION =    -31.153 KCAL =   -130.433 KJ; FOR REACTION COORDINATE =    175.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.069      1.401      0.000
H      1.887    -0.5542     0.9017
H      1.887    -0.5517    -0.9033
C    -0.5545     -1.396    -0.1221
H    -0.3724     0.4735     0.9466
H    -0.3730     0.6283    -0.8518
H      1.716      1.964     0.8981
H      3.185      1.377    0.01388
H      1.740      1.956    -0.9118
H    -0.2019     -2.035     0.7235
H     -1.671     -1.373    -0.1062
H    -0.2251     -1.869     -1.079
14
HEAT OF FORMATION =    -31.178 KCAL =   -130.537 KJ; FOR REACTION COORDINATE =    180.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.069      1.401      0.000
H      1.887    -0.5531     0.9024
H      1.887    -0.5532    -0.9025
C    -0.5547     -1.401 -1.716e-16
H    -0.3728     0.5531     0.9024
H    -0.3725     0.5532    -0.9025
H      1.728      1.960     0.9050
H      3.185      1.377 -0.0004156
H      1.728      1.960    -0.9048
H    -0.2140     -1.960     0.9050
H     -1.671     -1.377 -0.0004156
H    -0.2139     -1.960    -0.9048
14
HEAT OF FORMATION =    -31.154 KCAL =   -130.434 KJ; FOR REACTION COORDINATE =    185.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.070      1.401      0.000
H      1.887    -0.5517     0.9034
H      1.887    -0.5552    -0.9013
C    -0.5553     -1.395     0.1221
H    -0.3730     0.6283     0.8519
H    -0.3721     0.4745    -0.9463
H      1.738      1.957     0.9101
H      3.186      1.376   -0.01120
H      1.720      1.963    -0.8993
H    -0.2240     -1.870      1.077
H     -1.672     -1.372     0.1088
H    -0.2057     -2.034    -0.7248
14
HEAT OF FORMATION =    -31.081 KCAL =   -130.130 KJ; FOR REACTION COORDINATE =    190.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.070      1.400      0.000
H      1.887    -0.5487     0.9058
H      1.887    -0.5585    -0.8986
C    -0.5558     -1.379     0.2432
H    -0.3726     0.6976     0.7967
H    -0.3728     0.3940    -0.9819
H      1.753      1.951     0.9182
H      3.186      1.376   -0.02774
H      1.708      1.968    -0.8908
H    -0.2381     -1.762      1.243
H     -1.672     -1.360     0.2116
H    -0.1931     -2.093    -0.5355
14
HEAT OF FORMATION =    -30.966 KCAL =   -129.648 KJ; FOR REACTION COORDINATE =    195.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.072      1.400      0.000
H      1.889    -0.5476     0.9060
H      1.888    -0.5583    -0.8983
C    -0.5567     -1.352     0.3624
H    -0.3736     0.7635     0.7334
H    -0.3735     0.3068     -1.012
H      1.758      1.950     0.9204
H      3.188      1.375   -0.03235
H      1.706      1.970    -0.8884
H    -0.2432     -1.645      1.394
H     -1.673     -1.336     0.3246
H    -0.1907     -2.132    -0.3484
14
HEAT OF FORMATION =    -30.814 KCAL =   -129.014 KJ; FOR REACTION COORDINATE =    200.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.073      1.400      0.000
H      1.890    -0.5463     0.9066
H      1.889    -0.5600    -0.8969
C    -0.5581     -1.315     0.4787
H    -0.3748     0.8234     0.6651
H    -0.3738     0.2195     -1.034
H      1.769      1.946     0.9252
H      3.189      1.373   -0.04228
H      1.700      1.973    -0.8832
H    -0.2535     -1.513      1.535
H     -1.674     -1.305     0.4300
H    -0.1850     -2.156    -0.1553
14
HEAT OF FORMATION =    -30.636 KCAL =   -128.269 KJ; FOR REACTION COORDINATE =    205.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.076      1.399      0.000
H      1.892    -0.5448     0.9071
H      1.890    -0.5600    -0.8966
C    -0.5598     -1.268     0.5913
H    -0.3760     0.8771     0.5919
H    -0.3746     0.1286     -1.049
H      1.773      1.946     0.9260
H      3.191      1.372   -0.04398
H      1.702      1.973    -0.8822
H    -0.2574     -1.372      1.662
H     -1.675     -1.262     0.5398
H    -0.1859     -2.161    0.03428
14
HEAT OF FORMATION =    -30.444 KCAL =   -127.462 KJ; FOR REACTION COORDINATE =    210.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.078      1.399      0.000
H      1.894    -0.5448     0.9066
H      1.892    -0.5602    -0.8961
C    -0.5616     -1.211     0.6993
H    -0.3773     0.9251     0.5128
H    -0.3752    0.03713     -1.056
H      1.778      1.945     0.9267
H      3.194      1.370   -0.04556
H      1.704      1.973    -0.8814
H    -0.2612     -1.221      1.775
H     -1.677     -1.209     0.6453
H    -0.1874     -2.150     0.2234
14
HEAT OF FORMATION =    -30.249 KCAL =   -126.647 KJ; FOR REACTION COORDINATE =    215.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.081      1.398      0.000
H      1.896    -0.5452     0.9057
H      1.892    -0.5600    -0.8963
C    -0.5641     -1.145     0.8017
H    -0.3791     0.9661     0.4292
H    -0.3753   -0.05537     -1.055
H      1.781      1.945     0.9261
H      3.197      1.367   -0.04378
H      1.710      1.973    -0.8822
H    -0.2636     -1.062      1.874
H     -1.680     -1.144     0.7479
H    -0.1926     -2.122     0.4091
14
HEAT OF FORMATION =    -30.065 KCAL =   -125.876 KJ; FOR REACTION COORDINATE =    220.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.083      1.397      0.000
H      1.898    -0.5459     0.9048
H      1.893    -0.5585    -0.8970
C    -0.5660     -1.070     0.8980
H    -0.3804     0.9998     0.3422
H    -0.3757    -0.1487     -1.046
H      1.779      1.947     0.9234
H      3.199      1.364   -0.03783
H      1.718      1.971    -0.8855
H    -0.2612    -0.8976      1.959
H     -1.682     -1.069     0.8478
H    -0.2001     -2.079     0.5887
14
HEAT OF FORMATION =    -29.904 KCAL =   -125.201 KJ; FOR REACTION COORDINATE =    225.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.086      1.396      0.000
H      1.900    -0.5477     0.9027
H      1.893    -0.5572    -0.8982
C    -0.5683    -0.9872     0.9872
H    -0.3822      1.026     0.2510
H    -0.3754    -0.2412     -1.029
H      1.778      1.948     0.9209
H      3.202      1.361   -0.03220
H      1.725      1.969    -0.8880
H    -0.2603    -0.7262      2.029
H     -1.684    -0.9852     0.9396
H    -0.2074     -2.020     0.7646
14
HEAT OF FORMATION =    -29.776 KCAL =   -124.666 KJ; FOR REACTION COORDINATE =    230.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.089      1.395      0.000
H      1.901    -0.5500     0.9010
H      1.892    -0.5556    -0.8998
C    -0.5710    -0.8967      1.069
H    -0.3830      1.044     0.1578
H    -0.3744    -0.3322     -1.004
H      1.775      1.950     0.9170
H      3.205      1.357   -0.02436
H      1.736      1.966    -0.8925
H    -0.2573    -0.5510      2.083
H     -1.687    -0.8912      1.024
H    -0.2182     -1.948     0.9326
14
HEAT OF FORMATION =    -29.689 KCAL =   -124.303 KJ; FOR REACTION COORDINATE =    235.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.090      1.395      0.000
H      1.902    -0.5512     0.9001
H      1.893    -0.5535    -0.9010
C    -0.5717    -0.8001      1.143
H    -0.3834      1.053    0.06475
H    -0.3747    -0.4206    -0.9702
H      1.772      1.951     0.9149
H      3.206      1.357   -0.01943
H      1.742      1.965    -0.8953
H    -0.2541    -0.3698      2.123
H     -1.688    -0.7942      1.100
H    -0.2237     -1.860      1.096
14
HEAT OF FORMATION =    -29.651 KCAL =   -124.142 KJ; FOR REACTION COORDINATE =    240.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.394      0.000
H      1.903    -0.5547     0.8972
H      1.892    -0.5513    -0.9034
C    -0.5730    -0.6971      1.207
H    -0.3844      1.054   -0.03180
H    -0.3733    -0.5067    -0.9291
H      1.761      1.956     0.9070
H      3.208      1.355  -0.002957
H      1.757      1.959    -0.9033
H    -0.2428    -0.1926      2.148
H     -1.689    -0.6801      1.172
H    -0.2382     -1.762      1.245
14
HEAT OF FORMATION =    -29.661 KCAL =   -124.185 KJ; FOR REACTION COORDINATE =    245.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.395      0.000
H      1.902    -0.5564     0.8960
H      1.891    -0.5488    -0.9050
C    -0.5727    -0.5894      1.264
H    -0.3842      1.047    -0.1256
H    -0.3730    -0.5882    -0.8799
H      1.754      1.959     0.9031
H      3.207      1.356   0.005127
H      1.763      1.957    -0.9073
H    -0.2357  -0.009314      2.157
H     -1.689    -0.5683      1.231
H    -0.2445     -1.649      1.390
14
HEAT OF FORMATION =    -29.720 KCAL =   -124.430 KJ; FOR REACTION COORDINATE =    250.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.091      1.395      0.000
H      1.902    -0.5594     0.8942
H      1.891    -0.5468    -0.9066
C    -0.5726    -0.4769      1.310
H    -0.3840      1.032    -0.2194
H    -0.3725    -0.6650    -0.8238
H      1.744      1.962     0.8974
H      3.207      1.356    0.01693
H      1.771      1.953    -0.9126
H    -0.2256     0.1724      2.150
H     -1.689    -0.4478      1.280
H    -0.2531     -1.526      1.523
14
HEAT OF FORMATION =    -29.821 KCAL =   -124.853 KJ; FOR REACTION COORDINATE =    255.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.089      1.395      0.000
H      1.901    -0.5612     0.8930
H      1.888    -0.5450    -0.9087
C    -0.5717    -0.3610      1.347
H    -0.3831      1.008    -0.3109
H    -0.3708    -0.7367    -0.7616
H      1.736      1.964     0.8936
H      3.205      1.357    0.02435
H      1.776      1.951    -0.9164
H    -0.2181     0.3548      2.128
H     -1.688    -0.3278      1.317
H    -0.2581     -1.390      1.647
14
HEAT OF FORMATION =    -29.954 KCAL =   -125.411 KJ; FOR REACTION COORDINATE =    260.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.088      1.395      0.000
H      1.899    -0.5624     0.8926
H      1.887    -0.5437    -0.9099
C    -0.5707    -0.2423      1.374
H    -0.3821     0.9767    -0.3988
H    -0.3697    -0.8017    -0.6935
H      1.727      1.966     0.8893
H      3.204      1.359    0.03245
H      1.780      1.948    -0.9201
H    -0.2094     0.5343      2.091
H     -1.686    -0.2040      1.344
H    -0.2630     -1.244      1.759
14
HEAT OF FORMATION =    -30.104 KCAL =   -126.038 KJ; FOR REACTION COORDINATE =    265.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.087      1.396      0.000
H      1.898    -0.5628     0.8926
H      1.886    -0.5434    -0.9105
C    -0.5700    -0.1216      1.390
H    -0.3811     0.9382    -0.4829
H    -0.3689    -0.8597    -0.6207
H      1.719      1.969     0.8857
H      3.202      1.360    0.03933
H      1.784      1.946    -0.9233
H    -0.2027     0.7108      2.038
H     -1.685   -0.07936      1.358
H    -0.2672     -1.089      1.858
14
HEAT OF FORMATION =    -30.249 KCAL =   -126.647 KJ; FOR REACTION COORDINATE =    270.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.087      1.395      0.000
H      1.895    -0.5632     0.8933
H      1.884    -0.5435    -0.9109
C    -0.5706  8.544e-17      1.395
H    -0.3788     0.8933    -0.5632
H    -0.3678    -0.9109    -0.5435
H      1.720      1.969     0.8857
H      3.202      1.359    0.03892
H      1.784      1.946    -0.9233
H    -0.2041     0.8857      1.969
H     -1.686    0.03892      1.359
H    -0.2678    -0.9233      1.946
14
HEAT OF FORMATION =    -30.368 KCAL =   -127.147 KJ; FOR REACTION COORDINATE =    275.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.088      1.394      0.000
H      1.893    -0.5631     0.8941
H      1.882    -0.5448    -0.9106
C    -0.5725     0.1215      1.389
H    -0.3768     0.8417    -0.6389
H    -0.3666    -0.9546    -0.4634
H      1.728      1.968     0.8884
H      3.204      1.357    0.03196
H      1.781      1.947    -0.9205
H    -0.2126      1.057      1.883
H     -1.688     0.1501      1.349
H    -0.2654    -0.7473      2.020
14
HEAT OF FORMATION =    -30.445 KCAL =   -127.466 KJ; FOR REACTION COORDINATE =    280.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.091      1.393      0.000
H      1.890    -0.5629     0.8954
H      1.880    -0.5468    -0.9102
C    -0.5760     0.2419      1.372
H    -0.3747     0.7841    -0.7099
H    -0.3649    -0.9913    -0.3804
H      1.746      1.963     0.8959
H      3.207      1.351    0.01671
H      1.773      1.951    -0.9135
H    -0.2305      1.223      1.778
H     -1.692     0.2511      1.328
H    -0.2578    -0.5607      2.080
14
HEAT OF FORMATION =    -30.472 KCAL =   -127.578 KJ; FOR REACTION COORDINATE =    285.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.095      1.391      0.000
H      1.888    -0.5629     0.8962
H      1.878    -0.5488    -0.9098
C    -0.5804     0.3600      1.343
H    -0.3731     0.7200    -0.7757
H    -0.3629     -1.021    -0.2946
H      1.777      1.953     0.9110
H      3.211      1.345   -0.01321
H      1.755      1.960    -0.8988
H    -0.2623      1.386      1.651
H     -1.696     0.3353      1.302
H    -0.2405    -0.3608      2.126
14
HEAT OF FORMATION =    -30.453 KCAL =   -127.500 KJ; FOR REACTION COORDINATE =    290.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.098      1.389      0.000
H      1.886    -0.5622     0.8974
H      1.876    -0.5511    -0.9090
C    -0.5836     0.4752      1.306
H    -0.3717     0.6510    -0.8352
H    -0.3614     -1.043    -0.2070
H      1.809      1.941     0.9273
H      3.213      1.340   -0.04687
H      1.733      1.971    -0.8812
H    -0.2950      1.535      1.507
H     -1.698     0.4144      1.276
H    -0.2187    -0.1540      2.153
14
HEAT OF FORMATION =    -30.396 KCAL =   -127.263 KJ; FOR REACTION COORDINATE =    295.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.103      1.387      0.000
H      1.884    -0.5612     0.8991
H      1.874    -0.5543    -0.9075
C    -0.5891     0.5860      1.257
H    -0.3702     0.5776    -0.8886
H    -0.3603     -1.057    -0.1188
H      1.844      1.929     0.9414
H      3.216      1.333   -0.07874
H      1.716      1.980    -0.8634
H    -0.3296      1.668      1.350
H     -1.702     0.4922      1.242
H    -0.2018    0.05436      2.159
14
HEAT OF FORMATION =    -30.308 KCAL =   -126.893 KJ; FOR REACTION COORDINATE =    300.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.104      1.387      0.000
H      1.884    -0.5596     0.9003
H      1.874    -0.5568    -0.9062
C    -0.5893     0.6933      1.201
H    -0.3697     0.4998    -0.9348
H    -0.3596     -1.063   -0.02912
H      1.867      1.918     0.9535
H      3.214      1.335    -0.1067
H      1.695      1.989    -0.8471
H    -0.3531      1.785      1.185
H     -1.700     0.5749      1.209
H    -0.1809     0.2610      2.146
14
HEAT OF FORMATION =    -30.185 KCAL =   -126.380 KJ; FOR REACTION COORDINATE =    305.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.107      1.385      0.000
H      1.883    -0.5583     0.9015
H      1.874    -0.5594    -0.9044
C    -0.5926     0.7946      1.135
H    -0.3690     0.4182    -0.9744
H    -0.3595     -1.062    0.06046
H      1.883      1.913     0.9587
H      3.216      1.331    -0.1194
H      1.690      1.993    -0.8395
H    -0.3684      1.882      1.017
H     -1.702     0.6656      1.159
H    -0.1759     0.4553      2.114
14
HEAT OF FORMATION =    -30.026 KCAL =   -125.713 KJ; FOR REACTION COORDINATE =    310.00 DEG
C      0.000      0.000      0.000
C      1.514      0.000      0.000
C      2.110      1.384      0.000
H      1.882    -0.5565     0.9033
H      1.874    -0.5625    -0.9024
C    -0.5956     0.8895      1.060
H    -0.3680     0.3342     -1.007
H    -0.3596     -1.053     0.1492
H      1.899      1.906     0.9644
H      3.218      1.328    -0.1328
H      1.685      1.997    -0.8312
H    -0.3841      1.964     0.8404
H     -1.703     0.7517      1.102
H    -0.1703     0.6468      2.064
14
HEAT OF FORMATION =    -29.826 KCAL =   -124.875 KJ; FOR REACTION COORDINATE =    315.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.115      1.382      0.000
H      1.883    -0.5552     0.9043
H      1.875    -0.5648    -0.9007
C    -0.6002     0.9772     0.9772
H    -0.3676     0.2468     -1.032
H    -0.3600     -1.036     0.2375
H      1.904      1.906     0.9634
H      3.223      1.322    -0.1294
H      1.695      1.996    -0.8328
H    -0.3887      2.029     0.6667
H     -1.708     0.8430      1.026
H    -0.1796     0.8223      2.000
14
HEAT OF FORMATION =    -29.588 KCAL =   -123.878 KJ; FOR REACTION COORDINATE =    320.00 DEG
C      0.000      0.000      0.000
C      1.515      0.000      0.000
C      2.122      1.379      0.000
H      1.881    -0.5541     0.9063
H      1.875    -0.5675    -0.8991
C    -0.6069      1.056     0.8862
H    -0.3657     0.1581     -1.050
H    -0.3597     -1.013     0.3240
H      1.905      1.908     0.9593
H      3.231      1.312    -0.1198
H      1.713      1.991    -0.8394
H    -0.3903      2.078     0.4917
H     -1.716     0.9277     0.9348
H    -0.1976     0.9859      1.923
14
HEAT OF FORMATION =    -29.320 KCAL =   -122.758 KJ; FOR REACTION COORDINATE =    325.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.129      1.376      0.000
H      1.881    -0.5546     0.9060
H      1.876    -0.5697    -0.8975
C    -0.6130      1.127     0.7892
H    -0.3656    0.06540     -1.060
H    -0.3604    -0.9815     0.4084
H      1.902      1.913     0.9528
H      3.239      1.301    -0.1048
H      1.735      1.985    -0.8493
H    -0.3867      2.114     0.3168
H     -1.723      1.006     0.8323
H    -0.2195      1.139      1.834
14
HEAT OF FORMATION =    -29.036 KCAL =   -121.567 KJ; FOR REACTION COORDINATE =    330.00 DEG
C      0.000      0.000      0.000
C      1.516      0.000      0.000
C      2.136      1.373      0.000
H      1.881    -0.5546     0.9066
H      1.877    -0.5715    -0.8963
C    -0.6198      1.189     0.6864
H    -0.3647   -0.02698     -1.062
H    -0.3607    -0.9431     0.4904
H      1.897      1.919     0.9445
H      3.247      1.292   -0.08535
H      1.761      1.978    -0.8609
H    -0.3809      2.134     0.1415
H     -1.731      1.076     0.7197
H    -0.2451      1.282      1.734
14
HEAT OF FORMATION =    -28.751 KCAL =   -120.375 KJ; FOR REACTION COORDINATE =    335.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.143      1.370      0.000
H      1.880    -0.5559     0.9064
H      1.878    -0.5726    -0.8956
C    -0.6266      1.241     0.5788
H    -0.3637    -0.1207     -1.056
H    -0.3611    -0.8974     0.5697
H      1.890      1.926     0.9347
H      3.255      1.281   -0.06307
H      1.789      1.969    -0.8732
H    -0.3730      2.140   -0.03324
H     -1.739      1.134     0.5985
H    -0.2726      1.416      1.624
14
HEAT OF FORMATION =    -28.482 KCAL =   -119.250 KJ; FOR REACTION COORDINATE =    340.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.149      1.367      0.000
H      1.881    -0.5570     0.9057
H      1.879    -0.5727    -0.8953
C    -0.6319      1.285     0.4676
H    -0.3638    -0.2135     -1.042
H    -0.3620    -0.8444     0.6453
H      1.880      1.934     0.9239
H      3.262      1.273   -0.03974
H      1.816      1.961    -0.8855
H    -0.3626      2.133    -0.2069
H     -1.745      1.183     0.4728
H    -0.2986      1.540      1.503
14
HEAT OF FORMATION =    -28.248 KCAL =   -118.267 KJ; FOR REACTION COORDINATE =    345.00 DEG
C      0.000      0.000      0.000
C      1.517      0.000      0.000
C      2.154      1.365      0.000
H      1.880    -0.5590     0.9050
H      1.880    -0.5726    -0.8955
C    -0.6370      1.318     0.3532
H    -0.3628    -0.3057     -1.019
H    -0.3621    -0.7849     0.7168
H      1.872      1.939     0.9149
H      3.267      1.265   -0.02075
H      1.840      1.952    -0.8961
H    -0.3550      2.110    -0.3817
H     -1.750      1.217     0.3475
H    -0.3222      1.654      1.371
14
HEAT OF FORMATION =    -28.063 KCAL =   -117.493 KJ; FOR REACTION COORDINATE =    350.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.158      1.363      0.000
H      1.880    -0.5621     0.9031
H      1.880    -0.5713    -0.8964
C    -0.6403      1.342     0.2367
H    -0.3625    -0.3958    -0.9874
H    -0.3625    -0.7186     0.7833
H      1.865      1.944     0.9071
H      3.271      1.260  -0.004591
H      1.858      1.946    -0.9040
H    -0.3474      2.072    -0.5557
H     -1.753      1.240     0.2234
H    -0.3402      1.760      1.228
14
HEAT OF FORMATION =    -27.943 KCAL =   -116.992 KJ; FOR REACTION COORDINATE =    355.00 DEG
C      0.000      0.000      0.000
C      1.518      0.000      0.000
C      2.160      1.362      0.000
H      1.881    -0.5643     0.9014
H      1.881    -0.5690    -0.8980
C    -0.6424      1.357     0.1187
H    -0.3627    -0.4841    -0.9469
H    -0.3626    -0.6447     0.8454
H      1.865      1.946     0.9049
H      3.273      1.257  0.0004859
H      1.866      1.944    -0.9062
H    -0.3470      2.017    -0.7319
H     -1.755      1.253     0.1091
H    -0.3475      1.858      1.072
